methyl 2-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]-5-phenyl-benzoate

Systemtic Name: methyl 2-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]-5-phenyl-benzoate Openeye Name: methyl 2-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]-5-phenyl-benzoate CAS Name: 2-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]-5-phenylbenzoic acid methyl ester IUPAC Name: methyl 2-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]-5-phenylbenzoate Traditional Name: 2-[(2-butyl-4-methylol-1H-imidazol-5-yl)methyl]-5-phenyl-benzoic acid methyl ester Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1)CC2=C(C=C(C=C2)C3=CC=CC=C3)C(=O)OC)CO

Isomeric SMILES

CCCCC1=NC(=C(N1)CC2=C(C=C(C=C2)C3=CC=CC=C3)C(=O)OC)CO

InChI

InChI=1S/C23H26N2O3/c1-3-4-10-22-24-20(21(15-26)25-22)14-18-12-11-17(13-19(18)23(27)28-2)16-8-6-5-7-9-16/h5-9,11-13,26H,3-4,10,14-15H2,1-2H3,(H,24,25)